methyl 4-[[4-(2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl)phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-(2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl)phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-(2-cyano-3-oxo-3-pyrrolidin-1-yl-prop-1-enyl)phenoxy]methyl]benzoate CAS Name: 4-[[4-[2-cyano-3-oxo-3-(1-pyrrolidinyl)prop-1-enyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-cyano-3-oxo-3-pyrrolidin-1-ylprop-1-enyl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(2-cyano-3-keto-3-pyrrolidino-prop-1-enyl)phenoxy]methyl]benzoic acid methyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)C(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)C(=O)N3CCCC3

InChI

InChI=1S/C23H22N2O4/c1-28-23(27)19-8-4-18(5-9-19)16-29-21-10-6-17(7-11-21)14-20(15-24)22(26)25-12-2-3-13-25/h4-11,14H,2-3,12-13,16H2,1H3